SCHEMBL10246446

SCHEMBL10246446

CCCC(CO)NC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
LMNA P02545 4/20 0.36
CNR1 P21554 1/20 0.36
ADRA1A P35348 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ABCC3 O15438 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
ALDH1A1 P00352 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10245473 1.00 TSHR (0.39) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL10246425 1.00 TSHR (0.39) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL14266734 0.86 ALDH1A1 (0.41) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL18893422 0.85 TAS1R3 (0.30) TAS1R3TAS1R1
SCHEMBL437046 0.82 LMNA (0.38) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL10245268 0.80 LMNA (0.50) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL6209012 0.80 LMNA (0.50) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL13747070 0.80 CA1 (0.31) TAS1R3TAS1R1
SCHEMBL6209009 0.80 LMNA (0.50) TSHRLMNACNR1ADRA1ATDP1
SCHEMBL21790668 0.76 CA2 (0.38) TSHRTDP1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
US-20080058383-A1 Androgen Receptor Modulators KARO BIO AB (SE) 2008-03-06 US disclosed
US-20080058383-A1 Androgen Receptor Modulators KARO BIO AB (SE) 2008-03-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080058383-A1 Androgen Receptor Modulators NR5A1, ESRRA, AR TSHR 200/4885LMNA 2695/4885CNR1 469/4885
US-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 TSHR 1567/4885LMNA 1467/4885CNR1 4356/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.